2-(3-methyl-5-phenyl-4-prop-2-enyl-pyrazol-1-yl)ethanoic acid

Systemtic Name: 2-(3-methyl-5-phenyl-4-prop-2-enyl-pyrazol-1-yl)ethanoic acid Openeye Name: 2-(4-allyl-3-methyl-5-phenyl-pyrazol-1-yl)acetic acid CAS Name: 2-(3-methyl-5-phenyl-4-prop-2-enyl-1-pyrazolyl)acetic acid IUPAC Name: 2-(3-methyl-5-phenyl-4-prop-2-enylpyrazol-1-yl)acetic acid Traditional Name: 2-(4-allyl-3-methyl-5-phenyl-pyrazol-1-yl)acetic acid Formula: C15H16N2O2 MolecularWeight: 256.29974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CC=C)C2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC1=NN(C(=C1CC=C)C2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C15H16N2O2/c1-3-7-13-11(2)16-17(10-14(18)19)15(13)12-8-5-4-6-9-12/h3-6,8-9H,1,7,10H2,2H3,(H,18,19)